1-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-pentyl-thiourea

Systemtic Name: 1-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-pentyl-thiourea Openeye Name: 1-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-pentyl-thiourea CAS Name: 1-[[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]amino]-3-pentylthiourea IUPAC Name: 1-[[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]amino]thiourea Formula: C17H25N3O2S MolecularWeight: 335.4643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C=CC1=C(C=CC(=C1)C)OC

Isomeric SMILES

CCCCCNC(=S)NNC(=O)/C=C/C1=C(C=CC(=C1)C)OC

InChI

InChI=1S/C17H25N3O2S/c1-4-5-6-11-18-17(23)20-19-16(21)10-8-14-12-13(2)7-9-15(14)22-3/h7-10,12H,4-6,11H2,1-3H3,(H,19,21)(H2,18,20,23)/b10-8+