1-[(E)-hexan-2-ylideneamino]-3-phenethyl-thiourea

Systemtic Name: 1-[(E)-hexan-2-ylideneamino]-3-phenethyl-thiourea Openeye Name: 1-[(E)-1-methylpentylideneamino]-3-phenethyl-thiourea CAS Name: 1-[(E)-hexan-2-ylideneamino]-3-phenethylthiourea IUPAC Name: 1-[(E)-hexan-2-ylideneamino]-3-phenethylthiourea Traditional Name: 1-[(E)-1-methylpentylideneamino]-3-phenethyl-thiourea Formula: C15H23N3S MolecularWeight: 277.42822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNC(=S)NCCC1=CC=CC=C1)C

Isomeric SMILES

CCCC/C(=N/NC(=S)NCCC1=CC=CC=C1)/C

InChI

InChI=1S/C15H23N3S/c1-3-4-8-13(2)17-18-15(19)16-12-11-14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-12H2,1-2H3,(H2,16,18,19)/b17-13+