[4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-(4-thiazol-2-ylpiperazin-1-yl)methanone CAS Name: [4-(2-methoxyethylamino)-3-nitrophenyl]-[4-(2-thiazolyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-methoxyethylamino)-3-nitrophenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-(4-thiazol-2-ylpiperazino)methanone Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4S/c1-26-10-4-18-14-3-2-13(12-15(14)22(24)25)16(23)20-6-8-21(9-7-20)17-19-5-11-27-17/h2-3,5,11-12,18H,4,6-10H2,1H3