[4-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]methyl]phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]methyl]phenyl]-piperazin-1-yl-methanone Openeye Name: [4-[[allyl-[4-(3-nitrophenyl)thiazol-2-yl]amino]methyl]phenyl]-piperazin-1-yl-methanone CAS Name: [4-[[[4-(3-nitrophenyl)-2-thiazolyl]-prop-2-enylamino]methyl]phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enylamino]methyl]phenyl]-piperazin-1-ylmethanone Traditional Name: [4-[[allyl-[4-(3-nitrophenyl)thiazol-2-yl]amino]methyl]phenyl]-piperazino-methanone Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(C=C1)C(=O)N2CCNCC2)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC1=CC=C(C=C1)C(=O)N2CCNCC2)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O3S/c1-2-12-28(24-26-22(17-33-24)20-4-3-5-21(15-20)29(31)32)16-18-6-8-19(9-7-18)23(30)27-13-10-25-11-14-27/h2-9,15,17,25H,1,10-14,16H2