1-phenyl-3-[(Z)-[3-(phenylmethylidene)-2-piperidin-1-ium-1-yl-cyclopenten-1-yl]methylideneamino]thiourea

Systemtic Name: 1-phenyl-3-[(Z)-[3-(phenylmethylidene)-2-piperidin-1-ium-1-yl-cyclopenten-1-yl]methylideneamino]thiourea Openeye Name: 1-[(Z)-(3-benzylidene-2-piperidin-1-ium-1-yl-cyclopenten-1-yl)methyleneamino]-3-phenyl-thiourea CAS Name: 1-phenyl-3-[(Z)-[3-(phenylmethylene)-2-(1-piperidin-1-iumyl)-1-cyclopentenyl]methylideneamino]thiourea IUPAC Name: 1-[(Z)-(3-benzylidene-2-piperidin-1-ium-1-ylcyclopenten-1-yl)methylideneamino]-3-phenylthiourea Traditional Name: 1-[(Z)-(3-benzal-2-piperidin-1-ium-1-yl-cyclopenten-1-yl)methyleneamino]-3-phenyl-thiourea Formula: C25H29N4S+ MolecularWeight: 417.58956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2=C(CCC2=CC3=CC=CC=C3)C=NNC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)C2=C(CCC2=CC3=CC=CC=C3)/C=N\NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H28N4S/c30-25(27-23-12-6-2-7-13-23)28-26-19-22-15-14-21(18-20-10-4-1-5-11-20)24(22)29-16-8-3-9-17-29/h1-2,4-7,10-13,18-19H,3,8-9,14-17H2,(H2,27,28,30)/p+1/b21-18?,26-19-