N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: N-[(E)-[4-phenyl-2-(1-piperidyl)thiazol-5-yl]methyleneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: N-[(E)-[4-phenyl-2-(1-piperidinyl)-5-thiazolyl]methylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [(E)-(4-phenyl-2-piperidino-thiazol-5-yl)methyleneamino]-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine Formula: C21H27N5S MolecularWeight: 381.53758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NN=CC2=C(N=C(S2)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=NCC1)N/N=C/C2=C(N=C(S2)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5S/c1-4-10-17(11-5-1)20-18(16-23-25-19-12-6-2-7-13-22-19)27-21(24-20)26-14-8-3-9-15-26/h1,4-5,10-11,16H,2-3,6-9,12-15H2,(H,22,25)/b23-16+