1-butyl-3-[[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea

Systemtic Name: 1-butyl-3-[[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea Openeye Name: 1-butyl-3-[[1-[(2-chlorophenyl)methyl]-2-oxo-indolin-3-ylidene]amino]thiourea CAS Name: 1-butyl-3-[[1-[(2-chlorophenyl)methyl]-2-oxo-3-indolylidene]amino]thiourea IUPAC Name: 1-butyl-3-[[1-[(2-chlorophenyl)methyl]-2-oxoindol-3-ylidene]amino]thiourea Traditional Name: 1-butyl-3-[[1-(2-chlorobenzyl)-2-keto-indolin-3-ylidene]amino]thiourea Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C1C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCCNC(=S)NN=C1C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4OS/c1-2-3-12-22-20(27)24-23-18-15-9-5-7-11-17(15)25(19(18)26)13-14-8-4-6-10-16(14)21/h4-11H,2-3,12-13H2,1H3,(H2,22,24,27)