1-[(1-methylindol-3-yl)carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[(1-methylindol-3-yl)carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[(1-methylindole-3-carbonyl)amino]-3-pentyl-thiourea CAS Name: 1-[[(1-methyl-3-indolyl)-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[(1-methylindole-3-carbonyl)amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[(1-methylindole-3-carbonyl)amino]thiourea Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CN(C2=CC=CC=C21)C

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CN(C2=CC=CC=C21)C

InChI

InChI=1S/C16H22N4OS/c1-3-4-7-10-17-16(22)19-18-15(21)13-11-20(2)14-9-6-5-8-12(13)14/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,18,21)(H2,17,19,22)