1-[(3-cyanophenyl)carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[(3-cyanophenyl)carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[(3-cyanobenzoyl)amino]-3-pentyl-thiourea CAS Name: 1-[[(3-cyanophenyl)-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[(3-cyanobenzoyl)amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[(3-cyanobenzoyl)amino]thiourea Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H18N4OS/c1-2-3-4-8-16-14(20)18-17-13(19)12-7-5-6-11(9-12)10-15/h5-7,9H,2-4,8H2,1H3,(H,17,19)(H2,16,18,20)