1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3-(2,3-dimethylphenyl)thiourea

Systemtic Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3-(2,3-dimethylphenyl)thiourea Openeye Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxo-indolin-3-ylidene]amino]-3-(2,3-dimethylphenyl)thiourea CAS Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxo-3-indolylidene]amino]-3-(2,3-dimethylphenyl)thiourea IUPAC Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxoindol-3-ylidene]amino]-3-(2,3-dimethylphenyl)thiourea Traditional Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-keto-indolin-3-ylidene]amino]-3-(2,3-dimethylphenyl)thiourea Formula: C27H27N5OS MolecularWeight: 469.60118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C27H27N5OS/c1-18-8-7-12-23(19(18)2)28-27(34)30-29-25-22-11-5-6-13-24(22)32(26(25)33)17-31-15-14-20-9-3-4-10-21(20)16-31/h3-13H,14-17H2,1-2H3,(H2,28,30,34)