1-(4-butylphenyl)-3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]thiourea Openeye Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-butylphenyl)thiourea CAS Name: 1-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-butylphenyl)thiourea Traditional Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-butylphenyl)thiourea Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CN2)C(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CN2)C(=O)C

InChI

InChI=1S/C18H22N4O2S/c1-3-4-5-13-6-8-15(9-7-13)20-18(25)22-21-17(24)16-10-14(11-19-16)12(2)23/h6-11,19H,3-5H2,1-2H3,(H,21,24)(H2,20,22,25)