1-(3-chlorophenyl)-3-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]thiourea Openeye Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-(3-chlorophenyl)thiourea CAS Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-oxoethyl]amino]-3-(3-chlorophenyl)thiourea IUPAC Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-(3-chlorophenyl)thiourea Traditional Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-(3-chlorophenyl)thiourea Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NNC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H19ClN4O2S/c1-13(26)25-10-9-14-5-2-3-8-17(14)18(25)12-19(27)23-24-20(28)22-16-7-4-6-15(21)11-16/h2-11,18H,12H2,1H3,(H,23,27)(H2,22,24,28)/t18-/m0/s1