1-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-phenyl-thiourea Formula: C20H19IN4S MolecularWeight: 474.36113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)/C=N/NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H19IN4S/c1-14-12-16(15(2)25(14)19-10-8-17(21)9-11-19)13-22-24-20(26)23-18-6-4-3-5-7-18/h3-13H,1-2H3,(H2,23,24,26)/b22-13+