1-[(Z)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(Z)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]thiourea CAS Name: 1-[(Z)-(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-(2,5-dimethyl-1-phenylpyrrol-3-yl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]thiourea Formula: C17H20N4S MolecularWeight: 312.4325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C=NNC(=S)NCC=C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)/C=N\NC(=S)NCC=C

InChI

InChI=1S/C17H20N4S/c1-4-10-18-17(22)20-19-12-15-11-13(2)21(14(15)3)16-8-6-5-7-9-16/h4-9,11-12H,1,10H2,2-3H3,(H2,18,20,22)/b19-12-