1-[(E)-5-methylhexan-2-ylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(E)-5-methylhexan-2-ylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(E)-1,4-dimethylpentylideneamino]thiourea CAS Name: 1-[(E)-5-methylhexan-2-ylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(E)-5-methylhexan-2-ylideneamino]thiourea Traditional Name: 1-benzyl-3-[(E)-1,4-dimethylpentylideneamino]thiourea Formula: C15H23N3S MolecularWeight: 277.42822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=NNC(=S)NCC1=CC=CC=C1)C

Isomeric SMILES

CC(C)CC/C(=N/NC(=S)NCC1=CC=CC=C1)/C

InChI

InChI=1S/C15H23N3S/c1-12(2)9-10-13(3)17-18-15(19)16-11-14-7-5-4-6-8-14/h4-8,12H,9-11H2,1-3H3,(H2,16,18,19)/b17-13+