1-[(E)-(4-chloranyl-1-phenyl-butylidene)amino]-3-(2-pyridin-2-ylethyl)thiourea

Systemtic Name: 1-[(E)-(4-chloranyl-1-phenyl-butylidene)amino]-3-(2-pyridin-2-ylethyl)thiourea Openeye Name: 1-[(E)-(4-chloro-1-phenyl-butylidene)amino]-3-[2-(2-pyridyl)ethyl]thiourea CAS Name: 1-[(E)-(4-chloro-1-phenylbutylidene)amino]-3-[2-(2-pyridinyl)ethyl]thiourea IUPAC Name: 1-[(E)-(4-chloro-1-phenylbutylidene)amino]-3-(2-pyridin-2-ylethyl)thiourea Traditional Name: 1-[(E)-(4-chloro-1-phenyl-butylidene)amino]-3-[2-(2-pyridyl)ethyl]thiourea Formula: C18H21ClN4S MolecularWeight: 360.90414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC(=S)NCCC2=CC=CC=N2)CCCCl

Isomeric SMILES

C1=CC=C(C=C1)/C(=N/NC(=S)NCCC2=CC=CC=N2)/CCCCl

InChI

InChI=1S/C18H21ClN4S/c19-12-6-10-17(15-7-2-1-3-8-15)22-23-18(24)21-14-11-16-9-4-5-13-20-16/h1-5,7-9,13H,6,10-12,14H2,(H2,21,23,24)/b22-17+