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

Systemtic Name: 1-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-p-anisyl-thiourea Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H18N4O3S/c1-10(21)12-7-14(17-9-12)15(22)19-20-16(24)18-8-11-3-5-13(23-2)6-4-11/h3-7,9,17H,8H2,1-2H3,(H,19,22)(H2,18,20,24)