N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2-hydroxyethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Formula: C16H25N4O3S+ MolecularWeight: 353.4597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)N3CC[NH+](CC3)CCO)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)N3CC[NH+](CC3)CCO)C(=O)N

InChI

InChI=1S/C16H24N4O3S/c17-14(22)13-11-3-1-2-4-12(11)24-15(13)18-16(23)20-7-5-19(6-8-20)9-10-21/h21H,1-10H2,(H2,17,22)(H,18,23)/p+1