5-[(naphthalen-1-ylamino)methyl]-1-[(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(naphthalen-1-ylamino)methyl]-1-[(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-naphthylamino)methyl]-1-[(2-oxo-2-phenothiazin-10-yl-ethyl)amino]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-naphthalenylamino)methyl]-1-[[2-oxo-2-(10-phenothiazinyl)ethyl]amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(naphthalen-1-ylamino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-[(2-keto-2-phenothiazin-10-yl-ethyl)amino]-5-[(1-naphthylamino)methyl]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C35H27N5O3S2 MolecularWeight: 629.75058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)NCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)CNC6=CC=CC7=CC=CC=C76

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)NCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)CNC6=CC=CC7=CC=CC=C76

InChI

InChI=1S/C35H27N5O3S2/c41-32(39-28-17-6-8-19-30(28)45-31-20-9-7-18-29(31)39)22-37-40-34(43)26(33(42)38(35(40)44)24-13-2-1-3-14-24)21-36-27-16-10-12-23-11-4-5-15-25(23)27/h1-20,26,36-37H,21-22H2