1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]thiourea CAS Name: 1-[1-(2,4-dimethyl-3-pyrrolylidene)ethylamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]thiourea Traditional Name: 1-benzyl-3-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]thiourea Formula: C16H20N4S MolecularWeight: 300.4218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C1=C(C)NNC(=S)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CN=C(C1=C(C)NNC(=S)NCC2=CC=CC=C2)C

InChI

InChI=1S/C16H20N4S/c1-11-9-17-12(2)15(11)13(3)19-20-16(21)18-10-14-7-5-4-6-8-14/h4-9,19H,10H2,1-3H3,(H2,18,20,21)