1-[(2-heptoxyphenyl)carbonylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(2-heptoxyphenyl)carbonylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(2-heptoxybenzoyl)amino]thiourea CAS Name: 1-[[(2-heptoxyphenyl)-oxomethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(2-heptoxybenzoyl)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(2-heptoxybenzoyl)amino]thiourea Formula: C18H27N3O2S MolecularWeight: 349.49088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1C(=O)NNC(=S)NCC=C

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1C(=O)NNC(=S)NCC=C

InChI

InChI=1S/C18H27N3O2S/c1-3-5-6-7-10-14-23-16-12-9-8-11-15(16)17(22)20-21-18(24)19-13-4-2/h4,8-9,11-12H,2-3,5-7,10,13-14H2,1H3,(H,20,22)(H2,19,21,24)