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

Systemtic Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxo-indolin-3-ylidene]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxo-3-indolylidene]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-oxoindol-3-ylidene]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-keto-indolin-3-ylidene]amino]-3-(3-methoxyphenyl)thiourea Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NN=C2C3=CC=CC=C3N(C2=O)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H25N5O2S/c1-33-21-10-6-9-20(15-21)27-26(34)29-28-24-22-11-4-5-12-23(22)31(25(24)32)17-30-14-13-18-7-2-3-8-19(18)16-30/h2-12,15H,13-14,16-17H2,1H3,(H2,27,29,34)