5-[[(6-methyl-3-pentanoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[(6-methyl-3-pentanoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[(6-methyl-3-pentanoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[[6-methyl-3-(1-oxopentyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[(6-methyl-3-pentanoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[(6-methyl-3-valeryl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(SC2=C1CCC(C2)C)NC=C3C(=O)NC(=S)NC3=O

Isomeric SMILES

CCCCC(=O)C1=C(SC2=C1CCC(C2)C)NC=C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C19H23N3O3S2/c1-3-4-5-13(23)15-11-7-6-10(2)8-14(11)27-18(15)20-9-12-16(24)21-19(26)22-17(12)25/h9-10,20H,3-8H2,1-2H3,(H2,21,22,24,25,26)