1-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-oxoethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-3-p-cumenyl-thiourea Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)C[C@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C23H26N4O2S/c1-15(2)17-8-10-19(11-9-17)24-23(30)26-25-22(29)14-21-20-7-5-4-6-18(20)12-13-27(21)16(3)28/h4-13,15,21H,14H2,1-3H3,(H,25,29)(H2,24,26,30)/t21-/m0/s1